ethyl 4-(3-nitrophenyl)-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-(3-nitrophenyl)-3-oxidanylidene-butanoate Openeye Name: ethyl 4-(3-nitrophenyl)-3-oxo-butanoate CAS Name: 4-(3-nitrophenyl)-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(3-nitrophenyl)-3-oxobutanoate Traditional Name: 3-keto-4-(3-nitrophenyl)butyric acid ethyl ester Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC(=O)CC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H13NO5/c1-2-18-12(15)8-11(14)7-9-4-3-5-10(6-9)13(16)17/h3-6H,2,7-8H2,1H3